3-[(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-[(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
3-[(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 5999-5288 |
| Compound Name: | 3-[(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 484.68 |
| Molecular Formula: | C25 H32 N4 O2 S2 |
| Smiles: | CCCCCCCCN1C(/C(=C\C2=C(N=C3C=CC=CN3C2=O)N2CCCCC2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8205 |
| logD: | 5.8205 |
| logSw: | -5.2564 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 45.486 |
| InChI Key: | DYALPUFYMMSMCS-UHFFFAOYSA-N |